[3-(3-chlorophenyl)-2-sulfanylidene-imidazol-1-yl]methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [3-(3-chlorophenyl)-2-sulfanylidene-imidazol-1-yl]methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: [3-(3-chlorophenyl)-2-thioxo-imidazol-1-yl]methyl-[(3,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: [3-(3-chlorophenyl)-2-sulfanylidene-1-imidazolyl]methyl-[(3,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: [3-(3-chlorophenyl)-2-sulfanylideneimidazol-1-yl]methyl-[(3,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: [3-(3-chlorophenyl)-2-thioxo-4-imidazolin-1-yl]methyl-methyl-veratryl-ammonium Formula: C20H23ClN3O2S+ MolecularWeight: 404.93352

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OC)OC)CN2C=CN(C2=S)C3=CC(=CC=C3)Cl

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OC)OC)CN2C=CN(C2=S)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-22(13-15-7-8-18(25-2)19(11-15)26-3)14-23-9-10-24(20(23)27)17-6-4-5-16(21)12-17/h4-12H,13-14H2,1-3H3/p+1